%chk=000282663.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282663

0 1
O 3.589820 1.303046 -0.094520
O -3.621997 1.393420 -0.318983
O 2.529296 0.679398 -1.985130
O -2.494411 0.507759 -2.058367
O 0.792300 -4.911725 1.885351
O 1.184215 -2.996494 2.804473
N -0.077084 1.892188 1.857152
N 0.814964 -3.690635 1.867019
C -0.005062 0.568672 -0.676172
C 1.231185 1.139513 -0.011155
C -1.284604 1.111874 -0.068246
C -0.021394 -0.951477 -0.573116
C 1.175859 1.709679 1.224709
C -1.294771 1.674242 1.173687
C 0.403684 -1.604935 0.586951
C 2.446437 0.999377 -0.819480
C -2.457855 0.950274 -0.928421
C -0.490940 -1.707794 -1.661174
C 2.348337 2.190426 2.002249
C -2.512086 2.121884 1.901617
C 0.365930 -3.006948 0.638929
C -0.520577 -3.104328 -1.597915
C -0.089211 -3.767980 -0.448256
C 4.877212 1.135212 -0.770527
C -4.869751 1.251553 -1.070841
C 5.261811 -0.329360 -0.778439
C -5.370678 -0.173618 -0.963826
H 0.023673 0.855570 -1.769294
H -0.101360 2.261224 2.806634
H 0.766056 -1.041398 1.451887
H -0.851429 -1.191338 -2.559887
H 3.053668 1.355560 2.191893
H 2.940207 2.916779 1.410731
H 2.116542 2.655915 2.965726
H -3.033022 2.918790 1.334880
H -3.253720 1.299779 1.960700
H -2.343433 2.489711 2.919049
H -0.882017 -3.677911 -2.451957
H -0.102885 -4.859783 -0.384625
H 4.799153 1.558643 -1.788454
H 5.531130 1.755825 -0.132919
H -5.512963 1.982151 -0.549342
H -4.689170 1.559896 -2.116911
H 5.191484 -0.773192 0.222611
H 4.594836 -0.909229 -1.435414
H 6.286026 -0.475070 -1.140304
H -5.414327 -0.512255 0.078468
H -4.705109 -0.866646 -1.501425
H -6.372672 -0.280845 -1.395312


%chk=000282663-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282663

0 1
O 3.645475 1.460381 -0.271954
O -3.661618 1.454644 -0.308383
O 2.439780 0.492483 -2.022669
O -2.436765 0.498514 -2.051914
O 0.238169 -5.046456 2.117793
O 0.398713 -3.005715 3.119060
N -0.020351 1.760609 1.897435
N 0.257692 -3.755068 2.073390
C -0.003373 0.496858 -0.643976
C 1.261140 1.086020 -0.006446
C -1.280132 1.080439 -0.019017
C -0.009190 -1.042587 -0.553648
C 1.227599 1.622389 1.267989
C -1.261315 1.610947 1.258560
C 0.132803 -1.687245 0.695436
C 2.458692 0.974377 -0.855063
C -2.467704 0.972444 -0.880432
C -0.170728 -1.835464 -1.718006
C 2.393332 2.125499 2.092603
C -2.438564 2.098512 2.076380
C 0.109709 -3.096317 0.754244
C -0.188624 -3.247442 -1.639859
C -0.048367 -3.898258 -0.397938
C 4.879771 1.319877 -1.104435
C -4.885857 1.322188 -1.156655
C 5.495525 -0.072834 -0.940340
C -5.508895 -0.068796 -1.005780
H 0.000368 0.746266 -1.718837
H -0.025654 2.116414 2.854007
H 0.263573 -1.122238 1.622372
H -0.285949 -1.333934 -2.683554
H 3.188896 1.367692 2.157139
H 2.852183 3.012960 1.625212
H 2.068560 2.392800 3.115211
H -2.896509 2.989903 1.615482
H -3.230942 1.336144 2.122095
H -2.126013 2.354061 3.105819
H -0.311319 -3.841670 -2.551187
H -0.056997 -4.987088 -0.303785
H 4.616753 1.517859 -2.158088
H 5.541796 2.113399 -0.720826
H -5.549824 2.116514 -0.778089
H -4.609159 1.523505 -2.206133
H 5.711116 -0.288686 0.120630
H 4.815261 -0.846767 -1.332550
H 6.445187 -0.129903 -1.504440
H -5.737919 -0.288127 0.051672
H -4.826979 -0.843818 -1.392959
H -6.452050 -0.119888 -1.581265


